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benzoic acid, 4-(4-(3-bromophenyl)-4,6-dihydro-6-oxo-3-(2-thienyl)pyrrolo[3,4-c]pyrazol-5(1H)-yl)-, ethyl ester
SpectraBase Compound ID 4v6cYTUok5m
InChI InChI=1S/C24H18BrN3O3S/c1-2-31-24(30)14-8-10-17(11-9-14)28-22(15-5-3-6-16(25)13-15)19-20(18-7-4-12-32-18)26-27-21(19)23(28)29/h3-13,22H,2H2,1H3,(H,26,27)
InChIKey BAGKKUJVVLSRHI-UHFFFAOYSA-N
Mol Weight 508.39 g/mol
Molecular Formula C24H18BrN3O3S
Exact Mass 507.025226 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8iyh3zrcDwx
Name benzoic acid, 4-(4-(3-bromophenyl)-4,6-dihydro-6-oxo-3-(2-thienyl)pyrrolo[3,4-c]pyrazol-5(1H)-yl)-, ethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 507.025225623 u
Formula C24H18BrN3O3S
InChI InChI=1S/C24H18BrN3O3S/c1-2-31-24(30)14-8-10-17(11-9-14)28-22(15-5-3-6-16(25)13-15)19-20(18-7-4-12-32-18)26-27-21(19)23(28)29/h3-13,22H,2H2,1H3,(H,26,27)
InChIKey BAGKKUJVVLSRHI-UHFFFAOYSA-N
Molecular Weight 508.390 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_7421
Solvent DMSO-d6
Source Vendor ID: NMR/13308202